1-({6-[(2-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)-1H-benzotriazole
Chemical Structure Depiction of
1-({6-[(2-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)-1H-benzotriazole
1-({6-[(2-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)-1H-benzotriazole
Compound characteristics
| Compound ID: | D064-0410 |
| Compound Name: | 1-({6-[(2-ethoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)-1H-benzotriazole |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C19 H17 N7 O2 S |
| Smiles: | CCOc1ccccc1OCc1nn2c(Cn3c4ccccc4nn3)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 1.9818 |
| logD: | 1.9807 |
| logSw: | -2.186 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.687 |
| InChI Key: | IYJYTPSXPNRVCB-UHFFFAOYSA-N |